Materials Science and Engineering Commons^™

Novel Endohedral Derivatives Of Sc3n@C2n (N = 34, 40) And Unique Tether Controlled Bis-Functionalization Of Fullerenes, Maira Raquel Ceron Hernandez

Open Access Theses & Dissertations

Since the discovery of fullerenes in 1985, their exohedral functionalization has been necessary to increase their solubility and explore their properties and potential applications in materials science and medicinal chemistry. This Thesis provides a short overview of the importance of electronic, size and shape complementarity in determining the structures of specific endohedral fullerene compounds. This is followed by a description of a new method for the separation of scandium nitride endohedral fullerenes Sc3N@C2n (n = 34, 39 and 40), and their monofunctionalization.

We also present the regioselective synThesis of easily isolable bis-derivatives of C60, C70, and M3N@Ih-C80 (M = Sc, …

Transition States And Modeling For Co9s8/Mos2 Catalysis, Gabriel Angel Gonzalez

Open Access Theses & Dissertations

Transition state computational studies of the sulfur removal from dibenzothiophene (DBT) molecule have herein been performed considering the Co9S8/MoS2 interface existing on unsupported Co/MoS2 catalysts. The linear synchronous transit (LST) and quadratic synchronous transit (QST) methods integrated in a density functional theory (DFT) program such as Dmol3 were used for the calculations of energy barriers of the transition states. Three different configurations present on the Co9S8/MoS2 interface have been envisaged as possible catalytic sites: sulfur-sulfur (S, S) sites, and molybdenum-sulfur (Mo, S) and molybdenum-molybdenum (Mo, Mo) edge sites. This study revealed that the (Mo, Mo) edge site is the most …

An Improved Sin-Hyperbolic Constitutive Model For Creep Deformation And Damage, Mohammad Shafinul Haque

Open Access Theses & Dissertations

Inspection and maintenance of industrial gas turbines (IGTs) cost millions of dollars. Growing demand of obtaining higher IGT efficiency leads to higher temperature and pressure operating conditions. Long exposure of turbine components at elevated temperature and pressure

makes creep damage critically important to consider during planning, designing and operating conditions. Effective and economic maintenance requires accurate creep deformation, damage

evolution and rupture life prediction information. Creep prediction models are used to determine the state of the turbine components and to schedule the inspection, maintenance and replacement time periods. The more accurate the prediction model, the less is the overall cost …

Transition Metal Carbide (Tmc) Novel Materials For Novel Catalytic Applications, Svetlana Lagoykina

Open Access Theses & Dissertations

Transition metal carbides (TMC) constitute a diverse class of materials and traditionally have many technological applications. TMC became a subject of extensive research since 1973, when their platinum -like properties were discovered. They demonstrated high catalytical activity and selectivity in a variety of chemical reaction and have potential for some novel catalytic application.

This research is an effort to design new high effective, selective and stable bimetal or alkali promoted TMC catalyst. After extensive theoretical research a wide range of TMC, including bimetal and alkali promoted carbides, were synthesized by different methods. All solids were characterized by XRD and microscopy. …

Thermal Shock Studies On Carbon-Carbon Composites: Experimentation And Analysis, Alma Lucia Leanos

Open Access Theses & Dissertations

The oxidation behavior of C/C composites under thermal shock conditions in air is understood and predicted experimentally and by computational efforts. In Chapter. 1, both compressive properties and oxidation behavior of pristine and thermal shock exposed 2D C/C composite specimens were examined. Pristine test specimens were exposed to thermal shock conditions with temperatures ranging from 400°C to 1000°C in an oxidizing environment, followed by compression tests on pristine and thermal shock exposed specimens to obtain their compressive responses.

Similarly, in Chapter. 2, the influence of thermal shock conditions on both, the extent of carbon materials decomposition and the through-thickness compressive …

Investigation Of Lanthanide-Doped Anatase Tio2 Core-Shell Nanoparticles For Photocatalysis And Gas Sensing, Rezwanur Rahman

Graduate Theses/Dissertations

Anatase TiO2 has been shown to be potential applications for photo-remediation of chemical waste as well as for photocatalytic splitting of water. The catalytic properties of TiO2 materials can be modified by doping with lanthanide (Ln) ions. In order to minimize the distortion and/or change of the structure of TiO2 nanoparticles, surface doping of anatase TiO2 nanoparticles (~ 14 nm) with several Ln ions (Nd3+, Gd3+, Eu3+, Yb3+) has been successfully made. X-ray diffraction (XRD) and Raman characterization shows that the anatase phase of treated nanoparticles is well preserved. Scanning electron microscopy (SEM) shows that the majority of the nanoparticles …

Estimation Of Transient Temperature Distribution During Quenching, Via A Parabolic Model, Diego E. Lozano, Gabriela Martinez-Solis, Rafael David Mercado-Solis, Rafael Colás, George E. Totten

Mechanical and Materials Engineering Faculty Publications and Presentations

A material-independent model to estimate the transient temperature distribution in a test probe quenched by immersion is presented in this study. This model is based on the assumption that, under one-dimensional unsteady heat conduction, the radial temperature distribution at the end of an interval belongs to the equation of a parabola. The model was validated using AISI 304 stainless steel test probes (Φ8×40 mm and Φ12×60 mm) quenched from 850 to 900 °C in water and in water-based NaNO2 solutions at 25 °C and in canola oil at 50 °C. Additionally, square test probes (20×20×100 mm) were quenched from 550 …

Phase Transitions And In Situ Dynamics Of Crystal Grain Formation Of Alumina Nanotubes Templated By Vertically Aligned Carbon Nanotubes, L. F. Lampert, A. Barnum, S. W. Smith, J. F. Conley, Jun Jiao

Mechanical and Materials Engineering Faculty Publications and Presentations

Phase transitions of amorphous alumina (a-alumina) nanotubes grown by atomic layer deposition and templated by carbon nanotubes were investigated with thermal annealing, transmitted Kikuchi electron diffraction, electron-irradiation-induced crystallization, X-ray diffraction, and X-ray photoelectron spectroscopy. The resulting, engineered alumina nanotube arrays demonstrate a large range of tunable phases that are vital for understanding how alumina nanotube arrays can be applied for uses within biotechnology, catalysis, and other academic and industrial uses.

Anisotropy Of The Reynolds Stress Tensor In The Wakes Of Wind Turbine Arrays In Cartesian Arrangements With Counter-Rotating Rotors, Nicholas Hamilton, Raúl Bayoán Cal

Mechanical and Materials Engineering Faculty Publications and Presentations

A 4 × 3 wind turbine array in a Cartesian arrangement was constructed in a wind tunnel setting with four configurations based on the rotational sense of the rotor blades. The fourth row of devices is considered to be in the fully developed turbine canopy for a Cartesian arrangement. Measurements of the flow field were made with stereo particle-image velocimetry immediately upstream and downstream of the selected model turbines. Rotational sense of the turbine blades is evident in the mean spanwise velocity W and the Reynolds shear stress −vw. The flux of kinetic energy is shown to be of greater …

Biological Materials: Part A. Temperature-Responsive Polymers And Drug Delivery And Part B. Polymer Modification Of Fish Scale And Their Nano-Mechanical Properties, Xu Xiang

Dissertations, Master's Theses and Master's Reports - Open

This research has three parts. Two parts deal with novel nanoparticle assemblies for drug delivery, and are described in Part A, while the third part looks at properties of fish scales, an abundant and little-used waste resource, that can be modified to have value in medical and other areas.

Part A describes fundamental research into the affects of block sequence of amphiphilic block copolymers prepared from on a new and versatile class of monomers, oligo(ethylene glycol) methyl ether acrylate (OEGA) and the more hydrophobic di(ethylene glycol) methyl ether methacrylate (DEGMA). Polymers from these monomers are biologically safe and give polymers …

Nanomechanical And Scaling Behavior Of Nanoporous Gold, Nicolas J. Briot

Theses and Dissertations--Chemical and Materials Engineering

Nanoporous metals have recently been drawn significant interest in various fields of research. Their high surface-to-volume ratio present a strong potential for applications in sensing, catalysis, micro-electromechanical systems (MEMS) and even in the medical field. However, the mechanical properties of nanoporous metals have not yet been well determined, as conducting mechanical tests was found to be challenging. Scaling relations linking the mechanical properties of porous materials to those of their dense counterparts are successfully and widely used for many porous metals. However, their applicability to nanoporous metals have recently been questioned, as estimations from the classic scaling relations were found …

Nanoindentation Of A Zinc Metal Soap Mixture For Use In A Laser Printer, George A. Nimick

Theses and Dissertations--Chemical and Materials Engineering

At the start of this project, the possible choices of metal soaps had already been narrowed to include some of the zinc soaps used in this project. These zinc soaps are mixtures of zinc stearate and zinc palmitate of varying ratios purchased from a supplier. Zinc soap was chosen as result of its common use in various industries as a lubricant and mold release, which implied potential benefits in an electrophotographic printing system. These potential benefits include, but are not limited to, a more efficient transfer from a photoconductive drum and protection of the drum from mechanical and chemical degradation. …

Fundamental Studies Of Surfactant Templated Metal Oxide Materials Synthesis And Transformation For Adsorption And Energy Applications, Saikat Das

Theses and Dissertations--Chemical and Materials Engineering

This work addresses fundamental aspects of designing templates and curing conditions for the synthesis of mesoporous metal oxide thin films. The first section addresses selection of cationic-carbohydrate surfactant mixtures to synthesize templated silica thin films for selective adsorption of simple carbohydrates based on molecular imprinting. Nuclear magnetic resonance and fluorescence spectroscopy results suggest a novel structure for mixtures of alkyl glucopyranosides or xylopyranosides with cationic (trimethylammonium) surfactants. Despite thermodynamically favorable mixing, the carbohydrate headgroups in the mixed micelle adopt an inverted configuration with their headgroups in the micelle core, and therefore are inaccessible for molecular imprinting. This orientation occurs even …

Engineered Surface Properties Of Porous Tungsten From Cryogenic Machining, Julius M. Schoop

Theses and Dissertations--Chemical and Materials Engineering

Porous tungsten is used to manufacture dispenser cathodes due to it refractory properties. Surface porosity is critical to functional performance of dispenser cathodes because it allows for an impregnated ceramic compound to migrate to the emitting surface, lowering its work function. Likewise, surface roughness is important because it is necessary to ensure uniform wetting of the molten impregnate during high temperature service. Current industry practice to achieve surface roughness and surface porosity requirements involves the use of a plastic infiltrant during machining. After machining, the infiltrant is baked and the cathode pellet is impregnated. In this context, cryogenic machining is …

Microindentation Of Bi57in26sn17 Lead-Free Alloy, Ruiting Zhao

Theses and Dissertations--Chemical and Materials Engineering

There is great need to understand the mechanical properties of lead-free alloys—an alternative of lead-based alloys—to address the environmental problems associated with the use of lead-based materials in microelectronics. In this work, the microstructures of Bi57In26Sn17 lead-free alloy were examined using Optical Microscopy and Energy Dispersive X-ray Spectroscopy analysis. The micro-indentation technique was used to study the mechanical properties of Bi57In26Sn17 lead-free alloy. The experimental results of the hardness and contact modulus were presented and discussed. Local creep during the indentation was observed from the load-displacement curves. The Vickers hardness (HV) increases with the decrease of the indentation depth, suggesting …

Synthesis, Structure, Properties And Applications Of Nanoporous Silicon And Palladium, Xu Jiang

Theses and Dissertations--Chemical and Materials Engineering

Nanoporous (np) materials with pore size below 100 nano-meters exist naturally in biological and mineral structures, and synthetic np materials have been used industrially for centuries. Np materials have attracted significant research interest in recent decades, as the development of new characterization techniques and nanotechnology allow the observation and design of np materials at a new level. This study focuses on two np materials: nanoporous silicon (np-Si) and nanoporous palladium (np-Pd).

Silicon (Si), because of its high capacity to store lithium (Li), is increasingly becoming an attractive candidate as anode material for Li ion batteries (LIB). One significant problem with …

Evaporation-Induced Formation Of Well-Ordered Surface Patterns On Polymer Films, Wei Sun

Theses and Dissertations--Chemical and Materials Engineering

Various techniques of fabricating surface patterns of small scales have been widely studied due to the potential applications of surface patterns in a variety of areas. It is a challenge to fabricate well-ordered surface area efficiently and economically. Evaporation-induced surface patterning is a promising approach to fabricate well-ordered surface patterns over a large area at low cost. In this study, the evaporation-induced surface patterns with controllable geometrical characteristics have been constructed. The dewetting kinetics on deformable substrate is also investigated.

Using simple templates to control the geometry and the evaporation behavior of a droplet of volatile solvent, various gradient surface …

Fusion Welding Of Diboride-Carbide Ceramic Composites, Derek Scott King

Doctoral Dissertations

"Plasma and pulsed plasma arc welding (PAW and PPAW) processes were used to fusion weld ZrB₂ containing 20 vol% ZrC. Varying welding parameters resulted in changes in weld pool shape and size, and the size of ZrB₂ grains within the fusion zone. For PAW processes that resulted in a keyhole fusion zone (full penetration), the arc to workpiece power transfer efficiency was estimated to be 2 grain lengths were observed to decrease between binary PAW FZs (~1 mm in length), and binary PPAW FZs (~0.8 mm in length), and an increasing aspect ratio for ZrB₂ grains in …

Inclusion Engineering In Mn-Si De-Oxidized Steel For Thin-Strip Casting, Vivek Thapliyal

Doctoral Dissertations

"The focus of this research was to understand inclusion formation and evolution in Mn-Si de-oxidized steels used in thin-strip casting. Inclusions formation and evolution in ultra-low carbon low-alloyed steels were studied. Inclusion engineering can be used to remove or modify detrimental inclusions, which cause casting issues.

The first part of this study focused on inclusion formation as a result of ferro-alloy addition. De-oxidation reaction in steels are the primary source of the typical oxide inclusion formed in steel. For Mn-Si de-oxidized steels ferro-silicon and ferro-manganese are the two ferro-alloys used for de-oxidation. Inclusion formation and evolution during the early stages …

Characterization Of Investment Shell Thermal Properties, Mingzhi Xu

Doctoral Dissertations

Thermal properties of investment casting shells have a great influence on the solidification of metal and thus control the properties of the cast product. Computational simulation requires accurate thermal properties to better represent the real process. Due to the porosity and meta-stable materials used in the investment shells, it is difficult to determine the real time thermal properties as a function of components and thermal processing history. Previous studies measured the thermal properties using a variety of methods, but very few results can be directly used in simulations due to lack of accuracy.

This research developed a new methodology that …

Metallurgical Optimization Of High Strength Cast Steels With Stage I Tempering, Terrell Owen Webb Jr.

Doctoral Dissertations

“Eglin steel was developed by the U.S. Air Force and Ellwood National Forge Company as a cost-effective, ultrahigh strength steel for use in armament, aerospace, and commercial applications. Eglin steel has been successfully substituted for high alloy steels, such as AF1410 and HP-9-4-20/30, to produce the casing for “bunker buster” bombs where penetration of concrete barriers and rock at high velocity ( > 1000 ft/sec) is desired. Unlike AF1410 and HP-9-4-20/30, Eglin steel is low nickel (nominal 1 wt.%) and contains no cobalt. Given the successful performance of Eglin steel in the casings applications, the Department of Defense has directed that …

Measurements Of Rf Properties Of Thin Film Nb3Sn Superconducting Multilayers Using A Calorimetric Technique, S. Sosa-Guitron, A. Gurevich, J. Delayen, E. Chang Beom, C. Sundahl, G. V. Eremeev

Physics Faculty Publications

Results of RF tests of NB₃SN thin film samples related to the superconducting multilayer coating development are presented. We have investigated thin film samples of Nb₃Sn/Al₂O₃/Nb with Nb₃Sn layer thicknesses of 50 nm and 100 nm using a Surface Impedance Characterization system. These samples were measured in the temperature range 4 K-19 K, where significant screening by Nb₃Sn layers was observed below 16-17 K, consistent with the bulk critical temperature of Nb₃Sn.

Self-Assembly Kinetics Of Microscale Components: A Parametric Evaluation, Jose Miguel Carballo

USF Tampa Graduate Theses and Dissertations

The goal of the present work is to develop, and evaluate a parametric model of a basic microscale Self-Assembly (SA) interaction that provides scaling predictions of process rates as a function of key process variables. At the microscale, assembly by “grasp and release” is generally challenging. Recent research efforts have proposed adapting nanoscale self-assembly (SA) processes to the microscale. SA offers the potential for reduced equipment cost and increased throughput by harnessing attractive forces (most commonly, capillary) to spontaneously assemble components. However, there are challenges for implementing microscale SA as a commercial process. The existing lack of design tools prevents …

Nanohub.Org: A Gateway To Undergraduate Simulation-Based Research In Materials Science And Related Fields, Tanya A. Faltens, Peter A. Bermel, Amanda Buckles, K Anna Douglas, Alejandro H. Strachan, Lynn K. Zentner, Gerhard Klimeck

Birck and NCN Publications

Our future engineers and scientists will likely be required to use advanced simulations to solve many of tomorrow's challenges in nanotechnology. To prepare students to meet this need, the Network for Computational Nanotechnology (NCN) provides simulation-focused research experiences for undergraduates at an early point in their educational path, to increase the likelihood that they will ultimately complete a doctoral program. The NCN summer research program currently serves over 20 undergraduate students per year who are recruited nationwide, and selected by NCN and the faculty for aptitude in their chosen field within STEM, as well as complementary skills such as coding …

Influence Of Resonant And Non-Resonant Vibrational Excitation Of Ammonia Molecules In Gallium Nitride Synthesis, Hossein Rabiee Golgir, Yunshen Zhou, Kamran Keramatnejad, Yongfeng Lu

Department of Electrical and Computer Engineering: Dissertations, Theses, and Student Research

Attempts on the selective promotion of gallium nitride (GaN) growth were investigated by deploying laserassisted vibrational excitation of reactant molecules, which deposits energy selectively into specific molecules and activate the molecules towards the selected reaction pathways. Laser-assisted metal organic chemical vapor deposition (LMOCVD) of GaN was studied using a wavelength-tunable CO2 laser. The NH-wagging modes (υ2) of ammonia (NH3) precursor molecules are strongly infrared active and perfectly match the emission line of the CO2 laser at 9.219, 10.350, and 10.719 μm. On- and off-resonance excitations of molecules were performed via tuning the incident laser wavelengths at on-resonant wavelength 9.219 μm …

Understanding The Role Of Colloidal Particles In Electroporation Mediated Delivery, Alisha Peterson

USF Tampa Graduate Theses and Dissertations

Electroporation (EP) is a physical non-viral technique used to deliver therapeutic molecules across the cell membrane. During electroporation an external electric field is applied across a cell membrane and it causes pores to form. These pores then allow the surrounding media containing the therapeutics to diffuse across the membrane. This technique has been specifically studied as a promising gene and drug delivery system. Colloidal particles have also proven to be promising for a variety of biological applications including molecular delivery, imaging, and tumor ablation, due to their large surface area and tunable properties. In more recent years researchers have explored …

Systems Approach To Producing Electrospun Polyvinylidene Difluoride Fiber Webs With Controlled Fiber Structure And Functionality, Brian D. Bell

USF Tampa Graduate Theses and Dissertations

Polyvinylidene difluoride (PVDF) is a functional polymeric material that can be used for a wide variety of applications. There are many new future applications that were recently suggested for electrospun PVDF fibers. Electrospinning is a process capable of producing nano to micro sized PVDF fibers in a web. It is important to control the structure of the web during electrospinning because by controlling the structure of the web it is possible for the PVDF fiber web to have increased performance in comparison to other common forms of PVDF.

While past scientific literature focused on applications of PVDF fibers, little was …

Dissolution Of Borate Glasses And Precipitation Of Phosphate Compounds, Jaime Lynn George

Doctoral Dissertations

"Borate glasses have been developed for biomedical applications such as scaffolds for soft tissue and bone repair. The dissolution processes of borate glasses in phosphate-containing aqueous solutions were studied by µ-Raman spectroscopy which provided information about the types and concentrations of borate species released into the solution as a function of time and characterized the formation of calcium phosphate reaction products on the glass surface. Boric acid molecules (H₃BO₃) and borate anions (B(OH)₄^-) can be detected in solution and their relative concentrations depend on the solution pH.

Static and dynamic single-pass flow-through experiments …

Resistance Switching Of Electrodeposited Cuprous Oxide, Sanaz Yazdanparast

Doctoral Dissertations

In this work, the resistance switching behavior of electrodeposited cuprous oxide (Cu₂O) thin films in Au/Cu₂O/top electrode (Pt, Au-Pd, Al) cells was studied. After an initial FORMING process, the fabricated cells show reversible switching between a low resistance state (16.6 Ω) and a high resistance state (0.4 x 10⁶ Ω). Changing the resistance states in cuprous oxide films depends on the magnitude of the applied voltage which corresponds to unipolar resistance switching behavior of this material. The endurance and retention tests indicate a potential application of the fabricated cells for nonvolatile resistance switching random access …

Size Effects In Human Visual Inspection For Micro/Meso Scale Parts, Sri Harsha Kavuri

Department of Mechanical and Materials Engineering: Dissertations, Theses, and Student Research

Visual inspection has been a major method of quality control in conventional manufacturing processes for the last fifty years. Utilizing trained human inspectors to perform this visual inspection has been the most effective means of maintaining quality control. Extensive research has been performed to understand the factors that influence the human inspection process.

In the recent years, there has been a significant emphasis on manufacturing at the smaller end of the size-spectrum such as Micro and Meso scale manufacturing. Quality control at becomes a challenging task due to the extremely small sizes. Several automated visual inspection techniques have been proposed …